In-Silico Structure Database (LMISSD)
Common Name
PI(O-20:1(11Z)/10:0)
Systematic Name
1-(11Z-eicosenyl)-2-decanoyl-sn-glycero-3-phosphoinositol
LM ID
LMGP06029AU1
Status
Active (generated by computational methods)
Exact Mass
Calculate m/z
766.499618
Formula
Main
Classification
Category
Main Class
Sub Class
Glycerophospholipids [GP]
Glycerophosphoinositols [GP06]
1-alkyl,2-acylglycerophosphoinositols [GP0602]
String Representations
InChiKey (Click to copy)
ISSGIDJBDWUERA-GSYKHGQNSA-N
InChi (Click to copy)
InChI=1S/C39H75O12P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-23-25-27-29-48-30-32(50-33(40)28-26-24-22-10-8-6-4-2)31-49-52(46,47)51-39-37(44)35(42)34(41)36(43)38(39)45/h14-15,32,34-39,41-45H,3-13,16-31H2,1-2H3,(H,46,47)/b15-14-/t32-,34?,35-,36?,37?,38?,39-/m1/s1
SMILES (Click to copy)
[C@]([H])(OC(CCCCCCCCC)=O)(COP(=O)(O)O[C@@H]1C(O)[C@H](O)C(O)C(O)C1O)COCCCCCCCCCC/C=C\CCCCCCCC